Identifier Cleaner
Convert between SMILES, InChI, InChIKey, and compound names. Supports PubChem name resolution as a fallback when the input is a common drug name.
Example: aspirin
→ CC(=O)Oc1ccccc1C(=O)O
CC(=O)C1CCC2C3C[C@H](C)C4=CC(=O)CCC4(C)C3CCC12C
InChI=1S/C22H32O2/c1-13-11-16-18-6-5-17(14(2)23)21(18,3)10-8-19(16)22(4)9-7-15(24)12-20(13)22/h12-13,16-19H,5-11H2,1-4H3/t13-,16?,17?,18?,19?,21?,22?/m0/s1
GNFABWAPJFOZSF-SGEGZMIISA-N
328.5